cc_staff
163
edits
OpenMM: Difference between revisions
→Job submission
| Line 27: | Line 27: | ||
|contents= | |contents= | ||
#!/bin/bash | #!/bin/bash | ||
#SBATCH -cpus-per-task --gpus=1 | #SBATCH -cpus-per-task=1 --gpus=1 | ||
#SBATCH --mem-per-cpu=4000 --time=1:0:0 | #SBATCH --mem-per-cpu=4000 --time=1:0:0 | ||
# Usage: sbatch $0 | # Usage: sbatch $0 | ||